(2E) -2-Hexadecenoic Acid Ethyl Ester

CAT: 0024-sc-490445Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-490445Size:5 g

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CAS Number

135251-95-5

Chemical Information

(2E)-2-Hexadecenoic Acid Ethyl Ester

CAS Number	135251-95-5
PubChem CID	11778544
IUPAC Name	ethyl (E)-hexadec-2-enoate
Molecular Formula	C18H34O2
Molecular Weight	282.5
XLogP	7.7
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	15
Heavy Atom Count	20
Formal Charge	0
Complexity	234

SMILES

CCCCCCCCCCCCC/C=C/C(=O)OCC

InChI

InChI=1S/C18H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2/h16-17H,3-15H2,1-2H3/b17-16+

InChIKey

WKKVQOAYYIWUKZ-WUKNDPDISA-N

Chemical Structure

2D Structure

CAS: 135251-95-5

CID: 11778544

Formula: C18H34O2

MW: 282.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	282.5
XLogP3	7.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	15
Exact Mass	282.255880323
Monoisotopic Mass	282.255880323
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	234
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-489447	(2E) -2-Hexenoic Acid Ethyl-d5 Ester
sc-478297	(2E) -2,4-Pentadienoic Acid Ethyl Ester
sc-483065	(2E,4E) -4-Methyl-2,4-hexadienoic acid ethyl ester
sc-499780	(2E,4E) -2,4-Decadienoic acid ethyl ester
sc-478628	(2E) -2,4-Pentadienoic Acid Ethyl Ester-d5
sc-288121A	2-Hexadecenoic Acid
sc-288121	2-Hexadecenoic Acid
sc-205251A	Cis-7-Hexadecenoic Acid methyl ester
sc-205251	Cis-7-Hexadecenoic Acid methyl ester
sc-507079	Trans-2-Hexadecenoic acid

Catalog	Name
MBS6119418-01	(2E)-2-Hexadecenoic Acid Ethyl Ester
KFA25195	(2E) -2-Hexadecenoic acid ethyl ester
461347-01	O-TBS 9-Hexadecenoic Acid Ethyl Ester
440576-01	(9Z) -3-Hydroxy-9-hexadecenoic Acid Ethyl Ester
TRC-H635240-2.5MG	(11E)-11-Hexadecenoic Acid Methyl Ester
TRC-H635235-1MG	(7Z)-7-Hexadecenoic Acid Methyl Ester (Solution in Ethanol)
HY-78216-01	2-Thiooxamic acid ethyl ester
419186	2-Tetradecylhexadecanoic Acid Ethyl Ester
419005-01	2-Oxazolecarboxylic Acid Ethyl Ester
417460-01	2-Dodecyltetradecanoic Acid Ethyl Ester